2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-methoxy-2-quinolyl)sulfanyl]-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-[(3-cyano-6-methoxy-2-quinolinyl)thio]-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6-methoxyquinolin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-[(3-cyano-6-methoxy-2-quinolyl)thio]-N-(3,5-dimethylphenyl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N)C

InChI

InChI=1S/C21H19N3O2S/c1-13-6-14(2)8-17(7-13)23-20(25)12-27-21-16(11-22)9-15-10-18(26-3)4-5-19(15)24-21/h4-10H,12H2,1-3H3,(H,23,25)